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3.beta.-Deutero-17.beta.-methyl-5.beta.-androst-1-ene-3.alpha.,17.alpha.-diol
SpectraBase Compound ID 465VqmcHn7Y
InChI InChI=1S/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,13-17,21-22H,4-5,7-8,10-12H2,1-3H3/t13-,14-,15?,16?,17?,18+,19+,20-/m1/s1/i14D
InChIKey UMCBDWHORFFLCD-GLSKNTQOSA-N
Mol Weight 305.5 g/mol
Molecular Formula C20H312HO2
Exact Mass 305.246507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNjzHrU9nvr
Name 3.beta.-Deutero-17.beta.-methyl-5.beta.-androst-1-ene-3.alpha.,17.alpha.-diol
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 305.246507014 u
Formula C20H31[2H]O2
InChI InChI=1S/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,13-17,21-22H,4-5,7-8,10-12H2,1-3H3/t13-,14-,15?,16?,17?,18+,19+,20-/m1/s1/i14D
InChIKey UMCBDWHORFFLCD-GLSKNTQOSA-N
Molecular Weight 305.480 g/mol
Nominal Mass 305 u
Number of Peaks 44
SMILES O[C@]1([C@]2(CCC3[C@]4(C=C[C@@]([2H])(O)C[C@]4(CCC3C2CC1)[H])C)C)C
SPLASH splash10-0006-9740000000-a63185c8267014bb9928
Source File Reference DSHS_50_0696
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_696